Geometry & MOs

Info

ID:	153929
PubChem CID:	56313271
Reduced:	F2N2O2H20C21 (1)
Stoich.:	A2B2C2D20E21 (1)
Weight, g/mol:	356.190006
ΔH_f, kcal/mol:	-88.96
Dipole, Da:	6.53
IP(EA), eV:	-9.54(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-4-(2-methylpropanoylamino)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C2=CC=C(C=C2)F)C(=O)NCC(C)(C)C3=CC=CC=C3F

DOS

IR

Vibrations